CID 13706979

53839-34-2

Structural Information

Molecular Formula

C₁₀H₁₀O₂

SMILES

CC1=C(C2=CC=CC=C2O1)CO

InChI

InChI=1S/C10H10O2/c1-7-9(6-11)8-4-2-3-5-10(8)12-7/h2-5,11H,6H2,1H3

InChIKey

IXYAPYNZZPHJMW-UHFFFAOYSA-N

Compound name

(2-methyl-1-benzofuran-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 162.06808 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	163.07536	129.5
[M+Na]+	185.05730	143.9
[M+NH4]+	180.10190	139.2
[M+K]+	201.03124	139.2
[M-H]-	161.06080	133.3
[M+Na-2H]-	183.04275	136.2
[M]+	162.06753	132.8
[M]-	162.06863	132.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe